==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-AUG-05 2BZ6 . COMPND 2 MOLECULE: BLOOD COAGULATION FACTOR VIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.GROEBKE-ZBINDEN,U.OBST-SANDER,K.HILPERT,H.KUEHNE,D.W.BANNE . 307 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14026.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 28.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 20 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 1 5 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 16 H I 0 0 1 0, 0.0 2,-0.5 0, 0.0 186,-0.2 0.000 360.0 360.0 360.0 124.5 13.4 28.8 28.5 2 17 H V B +A 186 0A 12 184,-3.1 184,-1.8 1,-0.2 134,-0.1 -0.895 360.0 1.4-101.3 127.2 12.7 28.7 24.8 3 18 H G S S+ 0 0 48 132,-0.5 -1,-0.2 -2,-0.5 184,-0.1 0.665 102.3 109.6 75.2 21.5 14.6 26.3 22.6 4 19 H G - 0 0 31 -3,-0.2 2,-0.3 182,-0.1 144,-0.2 0.027 61.1-113.6-100.9-152.4 16.6 24.5 25.3 5 20 H K E -B 147 0B 131 142,-2.3 142,-2.9 -3,-0.1 2,-0.2 -0.929 38.3 -76.8-143.5 166.4 16.3 21.0 26.8 6 21 H V E -B 146 0B 53 -2,-0.3 140,-0.3 140,-0.2 139,-0.1 -0.475 45.4-125.5 -65.5 134.9 15.4 19.4 30.1 7 22 H a - 0 0 4 138,-3.0 138,-0.2 -2,-0.2 5,-0.2 -0.747 35.7-111.8 -77.8 115.2 18.3 19.8 32.5 8 23 H P > - 0 0 46 0, 0.0 3,-3.1 0, 0.0 4,-0.4 -0.318 46.4 -85.7 -55.8 137.7 18.9 16.2 33.6 9 24 H K T 3 S+ 0 0 57 1,-0.3 50,-0.1 2,-0.1 49,-0.0 -0.171 116.7 14.5 -49.8 124.6 17.8 15.9 37.3 10 25 H G T 3 S+ 0 0 11 48,-0.2 296,-0.4 95,-0.2 -1,-0.3 0.263 99.7 97.6 90.9 -9.5 20.8 16.9 39.4 11 26 H E S < S+ 0 0 60 -3,-3.1 -2,-0.1 1,-0.2 3,-0.1 0.568 88.2 42.9 -90.7 -3.5 22.8 18.6 36.6 12 27 H a S > S+ 0 0 15 -4,-0.4 3,-1.8 -5,-0.2 -1,-0.2 -0.449 73.1 155.0-125.8 56.8 21.5 22.1 37.6 13 28 H P T 3 + 0 0 4 0, 0.0 94,-1.2 0, 0.0 44,-0.3 0.593 65.8 58.0 -74.6 -8.4 21.9 21.7 41.4 14 29 H W T 3 S+ 0 0 9 92,-0.2 16,-2.4 94,-0.1 95,-0.2 0.492 78.0 118.0 -91.4 -8.6 22.3 25.4 42.2 15 30 H Q E < -J 29 0C 4 -3,-1.8 42,-0.5 14,-0.2 43,-0.4 -0.420 48.6-159.9 -65.1 133.3 18.9 26.3 40.6 16 31 H V E -JK 28 56C 0 12,-2.5 12,-1.2 21,-0.1 2,-0.5 -0.900 8.7-150.1-113.2 142.1 16.4 27.8 43.0 17 32 H L E -JK 27 55C 8 38,-2.5 38,-2.8 -2,-0.4 2,-0.4 -0.958 13.0-155.1-107.2 123.6 12.6 28.0 42.6 18 33 H L E -JK 26 54C 0 8,-3.1 7,-2.9 -2,-0.5 8,-1.1 -0.885 13.6-173.8 -99.7 132.6 11.0 31.0 44.3 19 34 H L E -JK 24 53C 32 34,-2.6 34,-2.6 -2,-0.4 2,-0.4 -0.944 16.6-162.5-124.6 144.2 7.3 30.7 45.3 20 35 H V E > S-JK 23 52C 31 3,-2.5 3,-1.8 -2,-0.3 32,-0.2 -0.986 87.1 -14.8-129.6 120.9 4.8 33.1 46.7 21 37 H N T 3 S- 0 0 126 30,-1.7 -1,-0.1 -2,-0.4 3,-0.1 0.856 130.0 -56.1 48.4 40.8 1.7 31.5 48.2 22 38 H G T 3 S+ 0 0 62 29,-0.4 2,-0.3 1,-0.3 -1,-0.3 0.290 113.4 120.0 82.6 -8.3 2.8 28.3 46.5 23 39 H A E < S-J 20 0C 54 -3,-1.8 -3,-2.5 1,-0.1 -1,-0.3 -0.680 74.3 -99.7 -94.6 142.8 2.8 29.9 43.0 24 40 H Q E +J 19 0C 66 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.345 48.6 161.3 -56.6 124.2 5.8 30.1 40.8 25 41 H L E - 0 0 45 -7,-2.9 2,-0.3 1,-0.4 -6,-0.2 0.764 53.7 -43.4-109.2 -56.4 7.5 33.6 41.0 26 42 H b E -J 18 0C 7 -8,-1.1 -8,-3.1 165,-0.1 -1,-0.4 -0.953 51.1 -99.2-165.5 169.0 11.0 33.4 39.8 27 43 H G E -J 17 0C 2 165,-2.9 12,-0.4 -2,-0.3 2,-0.3 -0.456 32.8-179.7 -92.2 178.9 14.3 31.5 39.7 28 44 H G E -J 16 0C 0 -12,-1.2 -12,-2.5 -2,-0.2 2,-0.4 -0.945 23.9-114.5-164.7 178.0 17.4 32.1 41.7 29 45 H T E -JL 15 37C 0 8,-2.4 8,-2.8 -2,-0.3 2,-0.4 -0.990 18.3-136.4-131.0 122.8 20.9 30.7 42.3 30 46 H L E + L 0 36C 0 -16,-2.4 79,-3.3 -2,-0.4 6,-0.2 -0.648 25.3 172.2 -73.1 128.0 22.3 29.1 45.4 31 47 H I - 0 0 7 4,-2.6 80,-0.4 -2,-0.4 2,-0.3 0.544 68.9 -9.9-116.1 -11.3 25.8 30.5 46.2 32 48 H N S S- 0 0 52 3,-1.1 -1,-0.4 78,-0.1 3,-0.3 -0.906 94.4 -72.3-163.2-172.3 26.3 28.9 49.7 33 49 H T S S+ 0 0 52 -2,-0.3 67,-2.5 1,-0.2 65,-0.1 0.703 127.9 23.0 -70.3 -14.2 24.1 27.1 52.1 34 50 H I S S+ 0 0 32 65,-0.2 62,-3.0 1,-0.1 2,-0.4 0.470 107.4 81.9-125.2 -2.8 22.1 30.2 53.2 35 51 H W E - M 0 95C 9 -3,-0.3 -4,-2.6 60,-0.2 -3,-1.1 -0.915 47.1-177.6-120.7 132.2 22.4 32.7 50.4 36 52 H V E -LM 30 94C 0 58,-2.6 58,-3.4 -2,-0.4 2,-0.4 -0.975 15.1-147.8-125.6 131.8 20.5 32.9 47.1 37 53 H V E +LM 29 93C 0 -8,-2.8 -8,-2.4 -2,-0.4 56,-0.2 -0.873 33.1 147.8 -98.5 129.4 21.0 35.4 44.3 38 54 H S E - M 0 92C 0 54,-2.8 54,-2.2 -2,-0.4 2,-0.4 -0.674 48.8 -72.8-139.8-165.6 18.0 36.4 42.3 39 55 H A > - 0 0 0 -12,-0.4 3,-1.3 52,-0.3 52,-0.3 -0.867 27.2-137.6-101.7 133.9 16.6 39.5 40.4 40 56 H A G > S+ 0 0 0 -2,-0.4 3,-2.2 1,-0.2 4,-0.1 0.875 101.7 64.8 -49.8 -42.0 15.4 42.6 42.2 41 57 H H G > S+ 0 0 54 1,-0.3 3,-1.4 2,-0.2 4,-0.2 0.718 83.7 75.2 -64.2 -19.7 12.4 42.9 39.8 42 58 H b G < S+ 0 0 8 -3,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.707 98.5 47.7 -57.5 -22.5 11.0 39.6 41.1 43 59 H F G X S+ 0 0 7 -3,-2.2 3,-1.1 -4,-0.3 -1,-0.2 0.346 75.2 106.2-106.6 6.9 9.9 41.4 44.2 44 60 H D T < S+ 0 0 54 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.788 91.7 32.7 -57.0 -31.8 8.2 44.5 42.6 45 60AH K T 3 S+ 0 0 183 -4,-0.2 -1,-0.2 -3,-0.2 2,-0.1 0.341 81.1 134.5-111.7 7.7 4.7 43.2 43.5 46 60BH I < + 0 0 30 -3,-1.1 3,-0.2 1,-0.2 -3,-0.1 -0.371 22.7 174.4 -64.9 130.2 5.2 41.3 46.8 47 60CH K S S+ 0 0 204 1,-0.3 2,-0.7 -2,-0.1 -1,-0.2 0.837 73.0 34.0 -99.2 -50.8 2.6 42.2 49.3 48 60DH N > - 0 0 87 1,-0.1 3,-1.6 3,-0.0 -1,-0.3 -0.907 62.7-169.2-112.7 108.9 3.4 39.7 52.1 49 61 H W G > S+ 0 0 57 -2,-0.7 3,-1.0 1,-0.3 24,-0.2 0.680 81.8 71.2 -66.3 -16.9 7.1 39.1 52.4 50 62 H R G 3 S+ 0 0 176 1,-0.3 -1,-0.3 -3,-0.1 23,-0.0 0.492 88.2 61.3 -84.6 -2.0 6.4 36.3 54.8 51 63 H N G < S+ 0 0 54 -3,-1.6 -30,-1.7 21,-0.1 2,-0.6 0.107 74.4 115.9-108.8 21.8 4.9 34.0 52.1 52 64 H L E < -K 20 0C 2 -3,-1.0 21,-1.7 21,-0.2 2,-0.4 -0.824 43.2-175.5 -94.6 122.1 8.1 33.8 50.0 53 65 H I E -KN 19 72C 47 -34,-2.6 -34,-2.6 -2,-0.6 2,-0.4 -0.932 15.4-152.6-120.1 138.9 9.6 30.3 49.8 54 66 H A E -KN 18 71C 0 17,-2.9 17,-2.6 -2,-0.4 2,-0.5 -0.936 12.1-160.9-106.9 133.8 12.8 29.1 48.2 55 67 H V E -KN 17 70C 11 -38,-2.8 -38,-2.5 -2,-0.4 2,-0.3 -0.974 5.9-171.6-121.2 127.6 13.0 25.5 46.9 56 68 H L E +KN 16 69C 0 13,-2.9 13,-3.1 -2,-0.5 -40,-0.1 -0.794 68.9 30.8-109.0 153.8 16.3 23.7 46.3 57 69 H G S S+ 0 0 8 -42,-0.5 10,-0.2 48,-0.4 -1,-0.2 0.637 82.4 151.3 72.3 17.8 16.7 20.3 44.6 58 70 H E + 0 0 33 -43,-0.4 -1,-0.2 -3,-0.3 -48,-0.2 -0.427 7.2 144.5 -80.2 152.1 13.6 20.9 42.5 59 71 H H + 0 0 16 4,-0.2 86,-1.3 1,-0.2 2,-0.7 0.285 65.2 31.0-146.5 -72.2 13.3 19.2 39.1 60 72 H D B > -Q 144 0D 26 84,-0.2 3,-1.5 1,-0.1 84,-0.2 -0.919 62.1-159.6-105.3 110.7 9.8 18.1 38.1 61 73 H L T 3 S+ 0 0 51 82,-2.9 -1,-0.1 -2,-0.7 83,-0.1 0.591 85.3 67.6 -66.0 -13.1 7.1 20.4 39.6 62 74 H S T 3 S+ 0 0 83 81,-0.3 2,-0.3 2,-0.0 -1,-0.3 0.633 104.5 39.7 -82.1 -13.7 4.4 17.7 39.1 63 75 H E < - 0 0 95 -3,-1.5 2,-0.5 0, 0.0 -4,-0.2 -0.870 67.0-132.7-134.9 163.7 5.9 15.3 41.7 64 76 H H + 0 0 151 -2,-0.3 -3,-0.1 1,-0.1 -6,-0.0 -0.986 26.2 167.3-111.5 126.6 7.6 15.1 45.1 65 77 H D - 0 0 55 -2,-0.5 -1,-0.1 -5,-0.1 -7,-0.0 0.415 53.7-108.0-120.8 3.3 10.7 12.8 45.0 66 78 H G S S+ 0 0 49 1,-0.0 -2,-0.0 -9,-0.0 -9,-0.0 0.308 99.4 93.3 91.0 -6.9 12.3 13.7 48.4 67 79 H D + 0 0 51 -10,-0.2 2,-0.2 2,-0.0 -9,-0.1 0.595 61.9 104.2 -91.7 -12.0 15.3 15.7 47.0 68 80 H E - 0 0 31 -13,-0.1 2,-0.4 -11,-0.0 -11,-0.2 -0.446 50.3-168.9 -70.7 142.0 13.5 19.0 47.4 69 81 H Q E -N 56 0C 28 -13,-3.1 -13,-2.9 -2,-0.2 2,-0.4 -0.974 3.6-163.8-132.3 120.1 14.3 21.3 50.2 70 82 H S E -N 55 0C 76 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.823 8.7-179.6-107.7 142.7 12.1 24.3 50.9 71 83 H R E -N 54 0C 37 -17,-2.6 -17,-2.9 -2,-0.4 2,-0.1 -0.988 29.1-115.3-137.1 145.0 13.1 27.3 53.1 72 84 H R E -N 53 0C 140 -2,-0.3 25,-2.7 -19,-0.2 2,-0.7 -0.485 34.3-119.2 -68.3 148.8 11.5 30.5 54.2 73 85 H V E -O 96 0C 8 -21,-1.7 23,-0.2 23,-0.2 -21,-0.2 -0.875 30.3-178.9 -95.4 115.4 13.1 33.6 52.9 74 86 H A E + 0 0 36 21,-2.4 2,-0.3 -2,-0.7 22,-0.2 0.710 66.5 16.3 -84.4 -30.5 14.4 35.7 55.9 75 87 H Q E -O 95 0C 7 20,-1.4 20,-2.1 168,-0.1 2,-0.5 -0.987 52.5-165.0-149.5 137.7 15.8 38.7 54.1 76 88 H V E -Op 94 248C 0 171,-2.4 173,-2.7 -2,-0.3 2,-0.5 -0.984 19.5-165.7-122.2 113.3 15.5 40.1 50.5 77 89 H I E -Op 93 249C 1 16,-2.8 16,-2.4 -2,-0.5 173,-0.2 -0.906 7.9-179.3-110.7 125.6 18.3 42.6 50.0 78 90 H I E - p 0 250C 13 171,-2.5 173,-2.4 -2,-0.5 14,-0.2 -0.933 32.7-104.6-125.1 139.5 18.1 45.0 47.0 79 91 H P E > - p 0 251C 0 0, 0.0 3,-1.6 0, 0.0 12,-0.1 -0.382 25.7-124.7 -63.9 144.8 20.7 47.7 46.0 80 92 H S T 3 S+ 0 0 41 171,-2.1 170,-0.0 1,-0.3 -2,-0.0 0.784 109.3 62.9 -56.6 -30.2 19.7 51.3 46.7 81 93 H T T 3 S+ 0 0 53 170,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.638 79.5 101.2 -78.0 -14.5 20.2 52.1 43.0 82 94 H Y < - 0 0 7 -3,-1.6 7,-0.1 7,-0.1 5,-0.1 -0.549 55.9-161.4 -72.2 130.5 17.4 49.7 41.8 83 95 H V > - 0 0 84 5,-0.5 3,-2.0 -2,-0.3 5,-0.1 -0.969 25.8-115.0-113.5 117.8 14.1 51.5 41.0 84 96 H P T 3 S+ 0 0 88 0, 0.0 3,-0.1 0, 0.0 -43,-0.1 -0.196 101.0 24.0 -51.9 136.9 11.0 49.2 40.9 85 97 H G T 3 S+ 0 0 69 1,-0.3 2,-0.2 -44,-0.1 -44,-0.0 0.399 108.7 91.2 85.6 -1.1 9.6 49.0 37.4 86 98 H T S < S- 0 0 70 -3,-2.0 -1,-0.3 2,-0.1 -45,-0.0 -0.732 74.5-125.5-120.5 173.8 12.9 49.9 35.7 87 99 H T + 0 0 38 -2,-0.2 3,-0.5 -3,-0.1 -46,-0.1 0.755 67.9 100.0 -95.6 -28.2 15.7 47.7 34.4 88 100 H N S S+ 0 0 43 1,-0.2 -5,-0.5 -7,-0.1 -2,-0.1 -0.268 86.0 12.7 -73.2 148.3 19.0 48.9 35.9 89 101 H H S S+ 0 0 16 1,-0.2 2,-2.0 -7,-0.1 -1,-0.2 0.879 73.9 179.9 62.2 46.8 20.7 47.1 38.9 90 102 H D + 0 0 4 -3,-0.5 2,-0.3 84,-0.2 136,-0.2 -0.458 32.1 114.6 -87.4 75.1 18.5 44.1 38.7 91 103 H I - 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